HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 2794613Erstellt: 4. November 2026
Methyl 3-(chlorosulfonyl)-4-methoxybenzoate
BUTTPARK 99\57-47 · Methyl 3-(chlorosulfonyl)-4-methoxybenzoate · Methyl 3-(chlorosulphonyl)-4-methoxybenzoate · Methyl3-(chlorosulphonyl)-4-methoxybenzoate90% · Methyl 3-(chlorosulphonyl)-4-methoxybenzoate 90% · Benzoic acid, 3-(chlorosulfonyl)-4-methoxy-, methyl ester · 2-(Chlorosulphonyl)-4-(methoxycarbonyl)anisole, 2-Methoxy-5-(methoxycarbonyl)benzenesulphonyl chloride
https://huagongshe.com/de/chemical/2794613
Identifikatoren & physikalische Daten
| CAS No. | 192323-12-9 |
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| Summenformel | C9H9ClO5S |
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| Durchschnittliche Molmasse | 264,68 g/mol |
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| Monoisotopische Masse | 263,98592207 g/mol |
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| SMILES | COC(=O)c1ccc(OC)c(S(=O)(=O)Cl)c1 |
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| InChIKey | FKAIQWMEWVOGDP-UHFFFAOYSA-N |
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| PubChem CID | 2794613 |
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| EC No. | 824-010-7 |
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| DTXSID | DTXSID50383259 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,8 |
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| Polarare Oberfläche (TPSA) | 78,1 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 16 |
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| Formalladung | 0 |
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| Komplexität | 347 |
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| Schmelzpunkt | 126 °C |
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| Siedepunkt | 394.0±32.0 °C(Predicted) |
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| Dichte | 1.407±0.06 g/cm3(Predicted) |
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| Aggregatzustand | powder |
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| Farbe | Off-white |
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| InChI | 1S/C9H9ClO5S/c1-14-7-4-3-6(9(11)15-2)5-8(7)16(10,12)13/h3-5H,1-2H3 |
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| InChIKey | FKAIQWMEWVOGDP-UHFFFAOYSA-N |
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| SMILES | O=C(OC)C1=CC=C(OC)C(S(=O)(Cl)=O)=C1 |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (50%) |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| Zollcode | 2916399090 |
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| R-Sätze (R) | 22 |
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| Gefahrensymbole | Xn |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 Oral |
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